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alpha-[(Benzyl-tert-butylamino)methyl]-3,4-bis(benzyloxy)-alpha-ethylbenzyl alcohol
SpectraBase Compound ID ALrafPG5mLI
InChI InChI=1S/C35H41NO3/c1-5-35(37,27-36(34(2,3)4)24-28-15-9-6-10-16-28)31-21-22-32(38-25-29-17-11-7-12-18-29)33(23-31)39-26-30-19-13-8-14-20-30/h6-23,37H,5,24-27H2,1-4H3
InChIKey MGJSTPISJPYFIJ-UHFFFAOYSA-N
Mol Weight 523.7 g/mol
Molecular Formula C35H41NO3
Exact Mass 523.308644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID xT02nYqNRa
Name alpha-[(Benzyl-tert-butylamino)methyl]-3,4-bis(benzyloxy)-alpha-ethylbenzyl alcohol
Comments Computed using HOSE algorithm
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Exact Mass 523.308644181 u
Formula C35H41NO3
InChI InChI=1S/C35H41NO3/c1-5-35(37,27-36(34(2,3)4)24-28-15-9-6-10-16-28)31-21-22-32(38-25-29-17-11-7-12-18-29)33(23-31)39-26-30-19-13-8-14-20-30/h6-23,37H,5,24-27H2,1-4H3
InChIKey MGJSTPISJPYFIJ-UHFFFAOYSA-N
Molecular Weight 523.717 g/mol
SMILES OC(C=1C=CC(=C(C1)OCC=1C=CC=CC1)OCC1=CC=CC=C1)(CN(CC=1C=CC=CC1)C(C)(C)C)CC